화학공학소재연구정보센터
검색결과 : 52건
No. Article
1 Mechanism of the charge separation improvement in carbon-nanodot sensitized g-C3N4
Ullah N, Chen SW, Zhang RQ
Applied Surface Science, 487, 151, 2019
2 Application of polar solvent effects in absorption spectra for determination of lowest electron-excited states of phthalide
Tseplin EE, Tseplina SN
Chemical Physics Letters, 716, 142, 2019
3 Singlet oxygen photogeneration by ethanolic extract of Syzygium cumini fruits: Theoretical elucidation through excited states computations
Diaz-Uribe C, Rodriguez-Serrano A, Lopez M, Schott E, Munoz A, Zarate X
Chemical Physics Letters, 715, 51, 2019
4 Effect of fluorination on bandgap, first and second order hyperpolarizabilities in lithium substituted adamantane: A time dependent density functional theory
Elavarasi SB, Mariam D, Momeen MU, Hu JP, Guin M
Chemical Physics Letters, 715, 310, 2019
5 Theoretical insights into the excited-state intermolecular hydrogen bonding dynamics of PRODAN derivative in toluene solution
Zhao D, Liu Y, Zhang X, Gao JW, Liu SX, Zhao Z
Chemical Physics Letters, 725, 109, 2019
6 Modulating NeH-based excited-state intramolecular proton transfer by different electron-donating/withdrawing substituents in 2-(2 '-aminophenyl) benzothiazole compounds
Yang DP, Zhang TJ, Jia M, Cheng SB
Chemical Physics Letters, 724, 57, 2019
7 Efficient determination of excitation energies and absorption spectra for quantum dots and large systems from ab initio data
Oyeniyi E, Akin-Ojo O
Chemical Physics Letters, 721, 12, 2019
8 Theoretical investigation on a series of phosphorescent heteroleptic cyclometalated iridium (III) complexes containing substituted 2-(3-sulfonylfluorophenyl)pyridine ligands
Han DM, Hao FQ, Li JM, Zhao LH
Molecular Crystals and Liquid Crystals, 690(1), 14, 2019
9 Role of organic cation in modern lead-based perovskites
Alwarappan G, Alam MR, Hassan WMI, Shibl MF, Alfalah S, Patil S, Nekovei R, Verma A
Solar Energy, 189, 86, 2019
10 Nanoparticle heterodimers: The role of size and interparticle gap distance on the optical response
Mokkath JH
Chemical Physics Letters, 699, 28, 2018